diethyl-[2-(5-methyl-2-oxidanylidene-3-propyl-1-benzofuran-3-yl)ethyl]azanium chloride

Systemtic Name: diethyl-[2-(5-methyl-2-oxidanylidene-3-propyl-1-benzofuran-3-yl)ethyl]azanium chloride Openeye Name: diethyl-[2-(5-methyl-2-oxo-3-propyl-benzofuran-3-yl)ethyl]ammonium chloride CAS Name: diethyl-[2-(5-methyl-2-oxo-3-propyl-3-benzofuranyl)ethyl]ammonium chloride IUPAC Name: diethyl-[2-(5-methyl-2-oxo-3-propyl-1-benzofuran-3-yl)ethyl]azanium chloride Traditional Name: diethyl-[2-(2-keto-5-methyl-3-propyl-coumaran-3-yl)ethyl]ammonium chloride Formula: C18H28ClNO2 MolecularWeight: 325.87342

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C2=C(C=CC(=C2)C)OC1=O)CC[NH+](CC)CC.[Cl-]

Isomeric SMILES

CCCC1(C2=C(C=CC(=C2)C)OC1=O)CC[NH+](CC)CC.[Cl-]

InChI

InChI=1S/C18H27NO2.ClH/c1-5-10-18(11-12-19(6-2)7-3)15-13-14(4)8-9-16(15)21-17(18)20;/h8-9,13H,5-7,10-12H2,1-4H3;1H